E-LIB Suche - Ergebnisse für: Kellenberger, Esther

1

Structural analysis of neomycin B and kanamycin A binding A..:

Revillo Imbernon, Julia ; Weibel, Jean‐Marc ; Ennifar, Eric..
Molecular Informatics. 43 (2024) 7 - p. , 2024

Link: https://doi.org/10.1002/..

2

THE IMS LIBRARY: FROM IN‐STOCK TO VIRTUAL:

Kellenberger, Esther ; Djikic-Stojsic, Teodora ; Bret, Guillaume...
ChemMedChem. , 2024

Link: https://doi.org/10.1002/..

3

Benchmarking AlphaFold-Generated Structures of Chemokine–Ch..:

Urvas, Lauri ; Chiesa, Luca ; Bret, Guillaume..
Journal of Chemical Information and Modeling. 64 (2024) 11 - p. 4587-4600 , 2024

Link: https://doi.org/10.1021/..

4

Mining the Protein Data Bank to inspire fragment library de..:

Revillo Imbernon, Julia ; Chiesa, Luca ; Kellenberger, Esther
Frontiers in Chemistry. 11 (2023) - p. , 2023

Link: https://doi.org/10.3389/..

5

Predicting the duration of action of β2‐adrenergic receptor..:

Chiesa, Luca ; Sick, Emilie ; Kellenberger, Esther
Molecular Informatics. 42 (2023) 12 - p. , 2023

Link: https://doi.org/10.1002/..

6

Structural Insights into Molecular Recognition and Receptor..:

Urvas, Lauri ; Kellenberger, Esther
Journal of Medicinal Chemistry. 66 (2023) 11 - p. 7070-7085 , 2023

Link: https://doi.org/10.1021/..

7

One class classification for the detection of β2 adrenergic..:

Chiesa, Luca ; Kellenberger, Esther
Journal of Cheminformatics. 14 (2022) 1 - p. , 2022

Link: https://doi.org/10.1186/..

8

Comprehensive analysis of commercial fragment libraries:

Revillo Imbernon, Julia ; Jacquemard, Célien ; Bret, Guillaume..
RSC Medicinal Chemistry. 13 (2022) 3 - p. 300-310 , 2022

Link: https://doi.org/10.1039/..

9

Modeling of CCR5 Recognition by HIV-1 gp120: How the Viral ..:

Jacquemard, Célien ; Koensgen, Florian ; Colin, Philippe..
Viruses. 13 (2021) 7 - p. 1395 , 2021

Link: https://doi.org/10.3390/..

10

Inhibition of the NAD salvage pathway in schistosomes impai..:

Schultz, Michael D. ; Dadali, Tulin ; Jacques, Sylvain A....
PLOS Pathogens. 16 (2020) 5 - p. e1008539 , 2020

Link: https://doi.org/10.1371/..

11

Unsupervised Classification of G-Protein Coupled Receptors ..:

Koensgen, Florian ; Da Silva, Franck ; Rognan, Didier.
Journal of Chemical Information and Modeling. 59 (2019) 9 - p. 3611-3618 , 2019

Link: https://doi.org/10.1021/..

12

Is it time for artificial intelligence to predict the funct..:

Liu, Miaomiao ; Karuso, Peter ; Feng, Yunjiang...
MedChemComm. 10 (2019) 10 - p. 1667-1677 , 2019

Link: https://doi.org/10.1039/..

13

Local Interaction Density (LID), a Fast and Efficient Tool ..:

Jacquemard, Célien ; Tran-Nguyen, Viet-Khoa ; Drwal, Malgorzata N...
Molecules. 24 (2019) 14 - p. 2610 , 2019

Link: https://doi.org/10.3390/..

14

Binding mode information improves fragment docking:

Jacquemard, Célien ; Drwal, Malgorzata N. ; Desaphy, Jérémy.
Journal of Cheminformatics. 11 (2019) 1 - p. , 2019

Link: https://doi.org/10.1186/..

15

Structural Insights on Fragment Binding Mode Conservation:

Drwal, Malgorzata N. ; Bret, Guillaume ; Perez, Carlos...
Journal of Medicinal Chemistry. 61 (2018) 14 - p. 5963-5973 , 2018

Link: https://doi.org/10.1021/..